Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28228710 | 0.85 | HSD17B3 (0.58) | SMN1; SMN2L3MBTL1ALDH1A1KMT2AMEN1 | |
| SCHEMBL1687863 | 0.83 | ALDH1A1 (0.64) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL9234729 | 0.81 | MAPT (0.55) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL27968649 | 0.80 | GSK3B (0.55) | ALDH1A1THRATHRB | |
| SCHEMBL8051337 | 0.80 | SMN1; SMN2 (0.70) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL27556690 | 0.79 | KMT2A (0.61) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL20278348 | 0.79 | MAPT (0.57) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL5630152 | 0.79 | KMT2A (0.60) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A | |
| SCHEMBL27535076 | 0.79 | SRD5A2 (0.44) | SMN1; SMN2MAPTALDH1A1KMT2AHTT | |
| SCHEMBL28022661 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2MAPTL3MBTL1ALDH1A1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109415359-A | heterocyclic GPR119 agonist compounds | 人类制药有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-108430994-A | Compound, composition and method for adjusting CFTR | 蛋白质平衡治疗股份有限公司 | 2018-08-21 | — | — | CN | disclosed |